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trans-4,5-Dihydroxythiocane
SpectraBase Compound ID HKaE8xEDahb
InChI InChI=1S/C7H14O2S/c8-6-2-1-4-10-5-3-7(6)9/h6-9H,1-5H2
InChIKey RDCZDCADHFEQJK-UHFFFAOYSA-N
Mol Weight 162.25 g/mol
Molecular Formula C7H14O2S
Exact Mass 162.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbUA5LSSxzJ
Name trans-4,5-Dihydroxythiocane
CAS Registry Number 73505-84-7
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H14O2S
InChI InChI=1S/C7H14O2S/c8-6-2-1-4-10-5-3-7(6)9/h6-9H,1-5H2
InChIKey RDCZDCADHFEQJK-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference J. Org. Chem. 45, 2641 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3